CAS
94094-43-6 Purity
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94094-43-6 Purity
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Isopropyl 4-(4-aminophenyl)butyrate hydrochloride
CAS
94094-47-0
Catalog Number
ACM94094470
Category
Other Products
Molecular Weight
257.756400 [g/mol]
Molecular Formula
C13H19NO2.HCl
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Specification
Synonyms
EINECS 302-148-4, CID3023512, Isopropyl 4-(4-aminophenyl)butyrate HCl, Isopropyl 4-(4-aminophenyl)butyrate hydrochloride, 94094-47-0
IUPAC Name
propan-2-yl 4-(4-aminophenyl)butanoate hydrochloride
Canonical SMILES
CC(C)OC(=O)CCCC1=CC=C(C=C1)N.Cl
InChI Key
GESOPNCBJZFTBM-UHFFFAOYSA-N
Boiling Point
346.3ºC at 760mmHg
Flash Point
192.4ºC
EC Number
302-148-4
Exact Mass
257.11800
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
The molecular formula is C13H20ClNO2.
What is the molecular weight of Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
The molecular weight is 257.75 g/mol.
What is the IUPAC Name of Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
propan-2-yl 4-(4-aminophenyl)butanoate;hydrochloride
What is the CAS number of Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
The CAS number is 94094-47-0.
How many hydrogen bond donor counts are there in Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
There are 2 hydrogen bond donor counts.
What is the topological polar surface area of Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
The topological polar surface area is 52.3 Ų.
How many rotatable bond counts are there in Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
There are 6 rotatable bond counts.
Is Isopropyl 4-(4-aminophenyl)butyrate hydrochloride a covalently-bonded unit?
Yes, it is a covalently-bonded unit.
What is the formal charge of Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
The formal charge is 0.
How many defined and undefined stereocenter counts are there in Isopropyl 4-(4-aminophenyl)butyrate hydrochloride?
There are 0 defined atom stereocenter counts and 0 undefined atom stereocenter counts.
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CAS
94094-51-6 Purity
96%
94094-51-6 Purity
96%
